Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.44 |
| ▸ | S1PR3 | Q99500 | 3/20 | 0.40 |
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.40 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.40 |
| ▸ | CACNA1H | O95180 | 4/20 | 0.36 |
| ▸ | AAK1 | Q2M2I8 | 5/20 | 0.36 |
| ▸ | GPR119 | Q8TDV5 | 2/20 | 0.35 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.33 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.33 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.33 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.33 |
| ▸ | KDM4D | Q6B0I6 | 1/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.33 |
| ▸ | JAK2 | O60674 | 1/20 | 0.33 |
| ▸ | JAK1 | P23458 | 1/20 | 0.33 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL7717657 | 0.73 | TRPA1 (0.41) | TRPA1S1PR3EGLN2S1PR1CACNA1H | |
| SCHEMBL7713105 | 0.72 | TRPA1 (0.48) | TRPA1S1PR3EGLN2S1PR1CACNA1H | |
| SCHEMBL7713179 | 0.70 | S1PR3 (0.41) | TRPA1S1PR3EGLN2S1PR1CACNA1H | |
| SCHEMBL1438634 | 0.68 | EGLN2 (0.58) | TRPA1EGLN2KCNQ3KCNQ2KCNE1 | |
| SCHEMBL6928939 | 0.65 | TRPA1 (0.54) | TRPA1EGLN2CACNA1H | |
| SCHEMBL5359320 | 0.65 | CNR1 (0.45) | TRPA1S1PR3EGLN2S1PR1CACNA1H | |
| SCHEMBL27669003 | 0.64 | EGLN2 (0.62) | TRPA1EGLN2GPR119KCNQ3KCNQ2 | |
| SCHEMBL20141383 | 0.63 | TRPA1 (0.52) | TRPA1EGLN2CACNA1HAAK1 | |
| SCHEMBL7933824 | 0.62 | TRPA1 (0.46) | TRPA1EGLN2CACNA1HAAK1 | |
| SCHEMBL30751802 | 0.62 | EGLN2 (0.49) | TRPA1EGLN2CACNA1HAAK1GPR119 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1214326-A1 | INHIBITORS OF PRENYL-PROTEIN TRANSFERASE | Merck & Co., Inc. (US) | 2002-06-19 | — | — | EP | disclosed |
| WO-2001018006-A1 | INHIBITORS OF PRENYL-PROTEIN TRANSFERASE | MERCK & CO., INC. (US) | 2001-03-15 | — | — | WO | disclosed |